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CHEBI:3043 - Benzoyltropein

ChEBI IDCHEBI:3043
ChEBI NameBenzoyltropein
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H19NO2
Net Charge0
Average Mass245.322
Monoisotopic Mass245.14158
SMILESCN1C2CCC1CC(OC(=O)c1ccccc1)C2
InChIInChI=1S/C15H19NO2/c1-16-12-7-8-13(16)10-14(9-12)18-15(17)11-5-3-2-4-6-11/h2-6,12-14H,7-10H2,1H3
InChIKeyXQJMXPAEFMWDOZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Benzoyltropein (CHEBI:3043) is a benzoate ester (CHEBI:36054)
Synonyms  Source
BenzoyltropeinKEGG COMPOUND
BenzoyltropineKEGG COMPOUND
Manual XrefsDatabases
C11381KEGG COMPOUND
C00025552KNApSAcK
Registry NumbersSources
CAS:19145-60-9KEGG COMPOUND